1,3,5-Triisopropyl-2,4-dinitrobenzene
TL;DR: 1,3,5-Triisopropyl-2,4-dinitrobenzene (CAS 85187-24-2) is a chemical compound with molecular formula C15H22N2O4 and molecular weight 294.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dinitro-1,3,5-tri(propan-2-yl)benzene
Also Known As: 1,3,5-Triisopropyl-2,4-dinitrobenzene, EINECS 286-111-7, 2,4-dinitro-1,3,5-tri(propan-2-yl)benzene, EC 286-111-7, 1,3,5-Tris(1-methylethyl)-2,4-dinitrobenzene
| Molecular Formula | C15H22N2O4 |
|---|---|
| Molecular Weight | 294.16 g/mol |
| LogP | 4.8732 |
| Topological Polar Surface Area | 86.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 294.15796 |
| Heavy Atoms | 21 |
| Complexity | 533.2766 |
Chemical Identifiers
| CAS Number | 85187-24-2 |
|---|---|
| SMILES | CC(C)C1=CC(=C(C(=C1[N+](=O)[O-])C(C)C)[N+](=O)[O-])C(C)C |
Product Overview
1,3,5-Triisopropyl-2,4-dinitrobenzene (CAS 85187-24-2), with molecular formula C15H22N2O4 and molecular weight 294.16 g/mol. IUPAC: 2,4-dinitro-1,3,5-tri(propan-2-yl)benzene.
Chemical Property Profile of 1,3,5-Triisopropyl-2,4-dinitrobenzene
Property Insights of 1,3,5-Triisopropyl-2,4-dinitrobenzene
The XLogP value of 4.8732 indicates that 1,3,5-Triisopropyl-2,4-dinitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Triisopropyl-2,4-dinitrobenzene. Following Lipinski's Rule of Five, 1,3,5-Triisopropyl-2,4-dinitrobenzene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3,5-Triisopropyl-2,4-dinitrobenzene?
The CAS number of 1,3,5-Triisopropyl-2,4-dinitrobenzene is 85187-24-2.
What is the molecular formula of 1,3,5-Triisopropyl-2,4-dinitrobenzene?
The molecular formula of 1,3,5-Triisopropyl-2,4-dinitrobenzene is C15H22N2O4.
What is the molecular weight of 1,3,5-Triisopropyl-2,4-dinitrobenzene?
The molecular weight of 1,3,5-Triisopropyl-2,4-dinitrobenzene is 294.16 g/mol.
Where can I buy 1,3,5-Triisopropyl-2,4-dinitrobenzene?
You can request a quote for 1,3,5-Triisopropyl-2,4-dinitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Triisopropyl-2,4-dinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Triisopropyl-2,4-dinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.